5537-0015 Screening compound: 1,3-dimethyl-5-phenyl-6-propyl-1H,2H,3H,4H,6H-pyrrolo[3,4-d]pyrimidine-2,4-dione

5537-0015 Screening compound: 1,3-dimethyl-5-phenyl-6-propyl-1H,2H,3H,4H,6H-pyrrolo[3,4-d]pyrimidine-2,4-dione
5537-0015 Screening compound: 1,3-dimethyl-5-phenyl-6-propyl-1H,2H,3H,4H,6H-pyrrolo[3,4-d]pyrimidine-2,4-dione alternative view

Chemical Structure Depiction of ChemDiv screening compound 5537-0015
1,3-dimethyl-5-phenyl-6-propyl-1H,2H,3H,4H,6H-pyrrolo[3,4-d]pyrimidine-2,4-dione

Available from 1 mg

Formats:

  • Glass Vials (4ml Glass Vials VWR #97047-678)
  • 96-tube racks (Matrix #4247 96-well 1.4ml sealed with capmats, empty cols 1 & 12, 100uL of 10mM)

Shiptime: 1 week worldwide delivery in most cases

Compound Identifiers

ChemDiv Compound ID

5537-0015

Molecular Formula

C17H19N3O2 (C17 H19 N3 O2)

Compound Name

1,3-dimethyl-5-phenyl-6-propyl-1H,2H,3H,4H,6H-pyrrolo[3,4-d]pyrimidine-2,4-dione

IUPAC name

13-dimethyl-5-phenyl-6-propyl-1H2H3H4H6H-pyrrolo[34-d]pyrimidine-24-dione

SMILES

CCCn(cc1N(C)C(N2C)=O)c(-c3ccccc3)c1C2=O

InChI

InChI=1S/C17H19N3O2/c1-4-10-20-11-13-14(15(20)12-8-6-5-7-9-12)16(21)19(3)17(22)18(13)2/h5-9,11H,4,10H2,1-3H3

InChI Key

QSLQZFHMTGYRIP-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD03449052

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

297.36

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

2.616

Distribution Coefficient, logD

2.616

Water Solubility, LogSw

-2.66

Polar Surface Area

32.578

Acid Dissociation Constant (pKa)

27.02

Base Dissociation Constant (pKb)

-0.75

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

29.40

5537-0015 in Drug Discovery

Included in Screening Libraries

Anti-Aging Library (44940 compounds)

Fragments Library (11262 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Musculoskeletal
  • Metabolic
  • Immune system
Mechanism of action:
  • Epigenetic
Structure:
  • Fragments

References: we are preparing a list of scientific research reports with 5537-0015 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 5537-0015?
Check Price and Availability of 5537-0015, then you can add required amount to the Shopping Cart. In the Shopping Cart you can again refine your selection. Once you are sure that it’s exactly what you want you can move forward with the Checkout (to pay online by credit card, or via PayPal), or Request a Quote.
What is the minimum amount of 5537-0015 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 5537-0015
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 5537-0015
  • 0.5–50 mg of dry powder sample in single glass vials, custom vials
  • DMSO solutions frozen 10μl–250μl@10mM (96 and 384 format)

Custom synthesis of 5537-0015 available by request